#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bwe s TYR 2 N 0.00 3.45 0.01 0.00 2.02 -1.26 -0.79 117.35 120.78 1bwe s TYR 2 Ca 0.00 0.38 0.01 0.00 -0.37 0.00 0.00 57.07 57.09 1bwe s TYR 2 Cb 0.00 -1.98 -0.01 0.00 -0.40 0.00 0.00 41.96 39.57 1bwe s TYR 2 CO 0.00 0.54 -0.02 0.08 -1.57 0.00 0.00 175.55 174.57 1bwe s VAL 3 N -0.55 0.16 0.79 0.71 1.01 0.46 -4.68 120.40 118.31 1bwe s VAL 3 Ca 0.12 -0.32 -0.12 0.00 0.00 0.00 0.00 61.98 61.66 1bwe s VAL 3 Cb -0.12 -0.19 0.07 0.00 0.00 0.00 0.00 36.38 36.15 1bwe s VAL 3 CO 0.02 -0.10 1.15 0.27 0.00 0.00 0.00 175.10 176.44 1bwe s ILE 4 N -0.42 2.54 0.08 2.22 -5.25 -1.26 -1.86 121.20 117.25 1bwe s ILE 4 Ca -0.03 0.21 -0.07 0.00 -0.99 0.00 0.00 60.65 59.77 1bwe s ILE 4 Cb -0.03 -2.58 -0.01 0.00 2.95 0.00 0.00 42.46 42.79 1bwe s ILE 4 CO -0.00 -0.19 0.15 0.42 -1.79 0.00 0.00 174.94 173.53 1bwe s THR 5 N -2.44 0.16 0.00 8.37 -4.23 -1.18 -4.83 115.64 111.49 1bwe s THR 5 Ca 0.68 -1.29 0.00 0.00 -1.18 0.00 0.00 61.69 59.90 1bwe s THR 5 Cb -0.24 -1.38 0.00 0.00 1.34 0.00 0.00 72.50 72.23 1bwe s THR 5 CO 0.51 -0.71 0.00 1.21 -0.54 0.00 0.00 174.62 175.10 1bwe n GLU 6 N -0.03 0.00 0.18 3.99 2.13 -1.26 -0.66 120.64 124.99 1bwe n GLU 6 Ca -0.15 0.00 0.18 0.00 0.66 0.00 0.00 57.16 57.85 1bwe n GLU 6 Cb 0.62 0.00 0.81 0.00 0.27 0.00 0.00 31.44 33.14 1bwe n GLU 6 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1bwe h PRO 7 N 0.00 0.00 -0.56 5.31 0.11 -1.98 -0.39 132.00 134.48 1bwe h PRO 7 Ca 0.00 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.18 1bwe h PRO 7 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 1bwe h PRO 7 CO 0.00 0.00 0.38 0.00 -0.21 0.00 0.00 178.00 178.17 1bwe s ILE 9 N -5.44 3.72 -0.50 0.00 1.09 -0.16 -4.67 121.20 115.24 1bwe s ILE 9 Ca -0.08 -1.04 0.08 0.00 -1.10 0.00 0.00 60.65 58.51 1bwe s ILE 9 Cb 0.19 -4.68 0.30 0.00 -1.06 0.00 0.00 42.46 37.21 1bwe s ILE 9 CO 0.75 -1.36 0.74 0.61 -0.10 0.00 0.00 174.94 175.57 1bwe n GLY 10 N 6.06 4.23 7.00 6.18 0.00 -1.26 -5.11 105.19 122.30 1bwe n GLY 10 Ca 0.43 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 44.24 1bwe n GLY 10 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1bwe n THR 11 N 0.58 0.00 -2.42 2.61 5.66 -1.26 -4.49 114.28 114.95 1bwe n THR 11 Ca 0.27 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.86 1bwe n THR 11 Cb 0.50 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.25 1bwe n THR 11 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1bwe s LYS 12 N 0.00 3.09 0.99 1.09 2.20 -1.24 -4.43 119.74 121.43 1bwe s LYS 12 Ca 0.00 0.03 -0.16 0.00 -0.36 0.00 0.00 55.97 55.48 1bwe s LYS 12 Cb 0.00 -4.21 0.21 0.00 -1.51 0.00 0.00 37.83 32.31 1bwe s LYS 12 CO 0.00 -2.24 1.29 0.00 -0.36 0.00 0.00 175.35 174.04 1bwe s ALA 14 N -3.76 -1.41 0.00 0.00 0.00 -1.26 -4.95 121.76 110.38 1bwe s ALA 14 Ca 0.73 1.78 0.00 0.00 0.00 0.00 0.00 51.96 54.47 1bwe s ALA 14 Cb -0.05 -1.05 0.00 0.00 0.00 0.00 0.00 23.12 22.02 1bwe s ALA 14 CO 0.53 -0.29 0.00 0.43 0.00 0.00 0.00 175.76 176.43 1bwe n SER 15 N 3.64 0.00 -1.59 0.00 7.64 -1.26 -4.94 113.62 117.10 1bwe n SER 15 Ca -0.18 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.69 1bwe n SER 15 Cb 0.57 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.76 1bwe n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bwe n VAL 17 N 1.61 0.00 -0.61 0.00 0.31 -1.26 -4.82 118.33 113.55 1bwe n VAL 17 Ca 0.01 0.14 -0.03 0.00 -0.01 0.00 0.00 64.34 64.45 1bwe n VAL 17 Cb 0.43 -1.04 -0.02 0.00 -0.91 0.00 0.00 33.84 32.30 1bwe n VAL 17 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1bwe n GLU 18 N -2.00 1.22 0.00 5.55 0.00 -1.26 -3.55 120.64 120.60 1bwe n GLU 18 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 57.16 56.88 1bwe n GLU 18 Cb 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 31.44 30.24 1bwe n GLU 18 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.13 178.68 1bwe n VAL 19 N 1.54 0.00 -1.97 3.84 3.14 -1.26 -5.08 118.33 118.53 1bwe n VAL 19 Ca 0.09 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.05 1bwe n VAL 19 Cb 0.56 -0.11 -0.03 0.00 -1.06 0.00 0.00 33.84 33.20 1bwe n VAL 19 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1bwe h PRO 21 N 7.42 0.30 -0.93 0.00 0.11 -1.98 -3.09 132.00 133.83 1bwe h PRO 21 Ca -0.42 -0.02 -0.43 0.00 0.11 0.00 0.00 66.00 65.24 1bwe h PRO 21 Cb 1.20 -0.07 -0.41 0.00 0.11 0.00 0.00 31.00 31.83 1bwe h PRO 21 CO 0.91 0.20 -0.98 1.33 -0.21 0.00 0.00 178.00 179.25 1bwe n VAL 22 N -4.66 1.73 0.00 3.15 0.24 -1.26 -5.09 118.33 112.44 1bwe n VAL 22 Ca 0.29 -3.74 0.00 0.00 -2.04 0.00 0.00 64.34 58.85 1bwe n VAL 22 Cb 1.03 -0.04 0.00 0.00 -1.47 0.00 0.00 33.84 33.36 1bwe n VAL 22 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1bwe n ASP 23 N -0.44 0.00 0.00 -1.34 2.03 -1.17 -4.83 116.55 110.80 1bwe n ASP 23 Ca 0.23 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.54 1bwe n ASP 23 Cb 0.81 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.21 1bwe n ASP 23 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bwe s ILE 25 N -0.51 4.00 0.01 0.00 -5.25 -1.26 -1.74 121.20 116.46 1bwe s ILE 25 Ca 0.00 0.51 0.08 0.00 -0.99 0.00 0.00 60.65 60.24 1bwe s ILE 25 Cb 0.00 -4.76 -0.03 0.00 2.95 0.00 0.00 42.46 40.62 1bwe s ILE 25 CO 0.00 -1.51 -0.23 -1.00 -1.79 0.00 0.00 174.94 170.42 1bwe s HIS 26 N 5.00 2.43 -1.23 1.37 3.76 0.41 -4.80 115.29 122.23 1bwe s HIS 26 Ca 0.36 -0.35 -0.19 0.00 -0.15 0.00 0.00 55.06 54.73 1bwe s HIS 26 Cb -0.09 -1.47 -0.01 0.00 1.11 0.00 0.00 32.58 32.12 1bwe s HIS 26 CO 0.19 0.12 1.88 0.39 -0.85 0.00 0.00 174.74 176.47 1bwe n GLU 27 N 1.99 2.48 -0.17 1.40 1.02 -1.26 0.15 120.64 126.26 1bwe n GLU 27 Ca -0.16 -2.79 -0.09 0.00 -0.02 0.00 0.00 57.16 54.09 1bwe n GLU 27 Cb 0.52 -3.49 0.00 0.00 -0.02 0.00 0.00 31.44 28.45 1bwe n GLU 27 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1bwe h GLY 28 N 14.01 0.85 0.00 0.62 0.00 -1.89 -3.45 103.07 113.22 1bwe h GLY 28 Ca 0.39 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1bwe h GLY 28 CO 1.49 0.52 0.00 1.18 0.00 0.00 0.00 176.54 179.73 1bwe n GLU 29 N -4.44 0.00 0.00 4.80 1.02 -1.26 -4.99 120.64 115.76 1bwe n GLU 29 Ca 0.01 0.00 0.10 0.00 -0.02 0.00 0.00 57.16 57.25 1bwe n GLU 29 Cb 0.24 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.57 1bwe n GLU 29 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1bwe n ASP 30 N 0.00 1.18 -4.34 1.62 2.03 -1.26 -5.00 116.55 110.78 1bwe n ASP 30 Ca 0.00 -1.09 -0.18 0.00 0.52 0.00 0.00 54.79 54.04 1bwe n ASP 30 Cb 0.00 0.88 -0.10 0.00 -0.72 0.00 0.00 41.12 41.18 1bwe n ASP 30 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bwe s GLN 31 N -2.76 1.31 -0.21 -0.67 1.03 -1.26 -3.73 119.66 113.37 1bwe s GLN 31 Ca 0.10 -1.61 -0.29 0.00 0.04 0.00 0.00 55.36 53.60 1bwe s GLN 31 Cb 0.16 -0.92 0.00 0.00 0.03 0.00 0.00 33.01 32.28 1bwe s GLN 31 CO 0.75 0.08 1.01 0.71 -2.54 0.00 0.00 175.29 175.31 1bwe s TYR 32 N -3.14 3.37 -0.24 9.60 2.02 -1.26 -3.55 117.35 124.15 1bwe s TYR 32 Ca 0.23 1.46 -0.09 0.00 -0.37 0.00 0.00 57.07 58.30 1bwe s TYR 32 Cb 0.02 -3.23 -0.04 0.00 -0.40 0.00 0.00 41.96 38.30 1bwe s TYR 32 CO 0.07 -0.43 0.13 0.71 -1.57 0.00 0.00 175.55 174.46 1bwe s TYR 33 N 2.95 3.24 -0.17 2.71 1.51 0.12 -4.79 117.35 122.92 1bwe s TYR 33 Ca 0.44 0.06 -0.21 0.00 -1.01 0.00 0.00 57.07 56.35 1bwe s TYR 33 Cb -0.16 -2.25 -0.03 0.00 -0.11 0.00 0.00 41.96 39.42 1bwe s TYR 33 CO 0.08 -0.04 0.61 0.42 -1.11 0.00 0.00 175.55 175.52 1bwe s ILE 34 N 1.15 5.05 -0.27 2.71 1.01 -1.26 -0.44 121.20 129.16 1bwe s ILE 34 Ca 0.06 1.17 -0.29 0.00 0.00 0.00 0.00 60.65 61.60 1bwe s ILE 34 Cb -0.14 -3.93 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 1bwe s ILE 34 CO 0.05 0.16 1.61 -0.62 0.00 0.00 0.00 174.94 176.14 1bwe s ASP 35 N 1.06 6.30 0.44 3.58 -1.08 -0.71 -4.81 116.67 121.44 1bwe s ASP 35 Ca 0.29 1.45 0.11 0.00 -0.52 0.00 0.00 52.55 53.89 1bwe s ASP 35 Cb -0.16 -2.53 0.96 0.00 -1.46 0.00 0.00 42.92 39.73 1bwe s ASP 35 CO 0.11 -1.35 2.03 1.55 0.52 0.00 0.00 175.17 178.03 1bwe h PRO 36 N 11.06 0.23 0.00 4.34 0.13 -1.83 -0.48 132.00 145.45 1bwe h PRO 36 Ca -0.33 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.75 1bwe h PRO 36 Cb 1.15 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1bwe h PRO 36 CO 1.02 0.25 -0.11 -0.44 -0.23 0.00 0.00 178.00 178.48 1bwe h ASP 37 N 0.23 0.00 0.26 1.44 3.32 -1.92 -3.10 116.42 116.66 1bwe h ASP 37 Ca 0.06 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.77 1bwe h ASP 37 Cb 0.15 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1bwe h ASP 37 CO 0.00 0.11 -1.81 0.58 -1.72 0.00 0.00 179.24 176.40 1bwe h VAL 38 N 0.00 0.83 -4.08 -1.35 2.07 -1.87 -3.47 116.25 108.37 1bwe h VAL 38 Ca -0.00 -2.52 -0.56 0.00 0.82 0.00 0.00 66.70 64.44 1bwe h VAL 38 Cb 1.08 2.60 0.15 0.00 -1.52 0.00 0.00 31.29 33.60 1bwe h VAL 38 CO 0.01 0.81 0.57 0.00 0.02 0.00 0.00 177.57 178.99 1bwe n ILE 40 N -1.49 2.30 -4.17 0.00 -5.35 -1.26 -4.76 119.36 104.63 1bwe n ILE 40 Ca 0.13 -3.88 -0.35 0.00 -0.27 0.00 0.00 62.75 58.38 1bwe n ILE 40 Cb 0.46 -0.70 -0.02 0.00 -1.74 0.00 0.00 39.64 37.64 1bwe n ILE 40 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1bwe n ASP 41 N -0.73 -3.40 -4.82 7.28 8.00 -1.26 -4.94 116.55 116.68 1bwe n ASP 41 Ca 0.36 -0.96 -0.31 0.00 0.71 0.00 0.00 54.79 54.58 1bwe n ASP 41 Cb 0.92 -2.78 0.04 0.00 -0.02 0.00 0.00 41.12 39.28 1bwe n ASP 41 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1bwe n GLY 43 N -1.85 4.64 3.78 0.00 0.00 -1.26 -4.84 105.19 105.66 1bwe n GLY 43 Ca 0.08 -1.77 -0.09 0.00 0.00 0.00 0.00 46.02 44.24 1bwe n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bwe s ALA 44 N 1.14 -0.74 0.00 4.61 0.00 -1.26 -4.94 121.76 120.56 1bwe s ALA 44 Ca 0.56 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.86 1bwe s ALA 44 Cb 0.16 0.83 0.00 0.00 0.00 0.00 0.00 23.12 24.11 1bwe s ALA 44 CO -0.06 -0.98 0.00 0.00 0.00 0.00 0.00 175.76 174.72 1bwe h GLU 46 N 0.00 -0.20 0.00 0.00 4.22 -1.92 0.38 114.58 117.06 1bwe h GLU 46 Ca 0.00 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.45 1bwe h GLU 46 Cb 0.00 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1bwe h GLU 46 CO 0.00 -0.14 0.00 0.00 -2.18 0.00 0.00 179.01 176.69 1bwe h ALA 47 N -0.98 1.00 0.13 2.92 0.00 -1.92 -2.32 119.26 118.09 1bwe h ALA 47 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.64 1bwe h ALA 47 Cb 0.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1bwe h ALA 47 CO -0.17 0.00 -1.30 0.28 0.00 0.00 0.00 179.25 178.06 1bwe h VAL 48 N 0.00 1.44 -2.18 0.00 2.07 -1.56 -3.43 116.25 112.59 1bwe h VAL 48 Ca 0.00 -3.01 -0.57 0.00 0.82 0.00 0.00 66.70 63.95 1bwe h VAL 48 Cb 0.22 2.93 0.01 0.00 -1.52 0.00 0.00 31.29 32.92 1bwe h VAL 48 CO 0.00 0.88 1.38 0.00 0.02 0.00 0.00 177.57 179.84 1bwe n PRO 50 N 8.24 0.25 -0.01 0.00 -0.04 -1.26 -1.04 135.00 141.15 1bwe n PRO 50 Ca 0.25 0.08 0.05 0.00 -0.04 0.00 0.00 63.50 63.85 1bwe n PRO 50 Cb 0.44 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.30 1bwe n PRO 50 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1bwe n VAL 51 N -1.13 0.04 -3.66 0.52 0.24 -1.26 -5.04 118.33 108.05 1bwe n VAL 51 Ca 0.07 -0.29 -0.25 0.00 -2.04 0.00 0.00 64.34 61.83 1bwe n VAL 51 Cb 0.06 0.17 0.04 0.00 -1.47 0.00 0.00 33.84 32.63 1bwe n VAL 51 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1bwe n SER 52 N -1.95 -3.44 0.12 -1.34 7.64 -0.21 -4.91 113.62 109.53 1bwe n SER 52 Ca -0.03 -0.91 0.13 0.00 1.01 0.00 0.00 58.87 59.07 1bwe n SER 52 Cb 0.35 -3.83 0.28 0.00 -1.01 0.00 0.00 64.21 60.01 1bwe n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1bwe h ALA 53 N 0.72 0.88 -2.38 -0.43 0.00 -1.87 -3.45 119.26 112.72 1bwe h ALA 53 Ca -0.63 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 53.73 1bwe h ALA 53 Cb 1.35 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1bwe h ALA 53 CO 0.52 0.00 0.41 0.42 0.00 0.00 0.00 179.25 180.60 1bwe s ILE 54 N -3.15 4.85 0.23 0.00 1.01 -1.26 -3.08 121.20 119.80 1bwe s ILE 54 Ca 0.08 2.05 0.02 0.00 0.00 0.00 0.00 60.65 62.81 1bwe s ILE 54 Cb 0.11 -4.32 -0.05 0.00 0.01 0.00 0.00 42.46 38.21 1bwe s ILE 54 CO 0.65 0.13 0.05 -0.31 0.00 0.00 0.00 174.94 175.46 1bwe s TYR 55 N 1.20 1.47 0.48 3.97 2.02 -0.78 -4.92 117.35 120.79 1bwe s TYR 55 Ca 0.51 -1.08 -0.23 0.00 -0.37 0.00 0.00 57.07 55.90 1bwe s TYR 55 Cb -0.21 -0.86 -0.07 0.00 -0.40 0.00 0.00 41.96 40.43 1bwe s TYR 55 CO 0.26 -0.24 1.29 -1.01 -1.57 0.00 0.00 175.55 174.29 1bwe s HIS 56 N -3.65 2.61 0.27 2.71 3.76 -1.26 -0.40 115.29 119.33 1bwe s HIS 56 Ca 0.32 1.42 0.01 0.00 -0.15 0.00 0.00 55.06 56.66 1bwe s HIS 56 Cb 0.07 -3.65 0.56 0.00 1.11 0.00 0.00 32.58 30.66 1bwe s HIS 56 CO 0.10 -2.29 1.80 1.05 -0.85 0.00 0.00 174.74 174.55 1bwe h GLU 57 N 2.01 0.81 -0.09 1.40 4.11 -1.29 0.42 114.58 121.93 1bwe h GLU 57 Ca -0.50 -0.05 -0.06 0.00 0.07 0.00 0.00 59.36 58.82 1bwe h GLU 57 Cb 1.27 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 1bwe h GLU 57 CO 0.60 0.53 -0.22 0.38 0.07 0.00 0.00 179.01 180.37 1bwe h ASP 58 N 0.83 0.15 0.46 3.06 2.03 -1.91 -3.24 116.42 117.81 1bwe h ASP 58 Ca 0.49 -0.04 -0.30 0.00 -0.73 0.00 0.00 57.03 56.45 1bwe h ASP 58 Cb 0.58 -0.04 0.01 0.00 -0.83 0.00 0.00 39.33 39.05 1bwe h ASP 58 CO -0.31 0.39 -1.41 0.15 -1.03 0.00 0.00 179.24 177.03 1bwe h PHE 59 N 0.15 0.63 -1.71 4.15 3.04 -0.60 -3.45 116.94 119.15 1bwe h PHE 59 Ca 0.03 -0.46 -0.68 0.00 3.98 0.00 0.00 57.97 60.84 1bwe h PHE 59 Cb 0.48 -0.03 0.04 0.00 2.56 0.00 0.00 35.95 39.01 1bwe h PHE 59 CO 0.00 1.41 0.60 0.28 -2.02 0.00 0.00 178.31 178.58 1bwe n VAL 60 N -3.56 0.09 -1.65 1.41 0.31 -0.22 -4.89 118.33 109.82 1bwe n VAL 60 Ca -0.14 -0.02 -0.42 0.00 -0.01 0.00 0.00 64.34 63.76 1bwe n VAL 60 Cb 1.05 -1.00 0.01 0.00 -0.91 0.00 0.00 33.84 32.99 1bwe n VAL 60 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1bwe n PRO 61 N 3.35 1.62 -0.33 5.55 -0.02 -1.26 -4.49 135.00 139.42 1bwe n PRO 61 Ca 0.20 0.58 0.15 0.00 -2.02 0.00 0.00 63.50 62.41 1bwe n PRO 61 Cb 0.19 -2.16 0.30 0.00 -0.02 0.00 0.00 33.50 31.81 1bwe n PRO 61 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1bwe h GLU 62 N 1.88 0.05 -0.77 -0.52 3.07 -1.93 0.45 114.58 116.81 1bwe h GLU 62 Ca -0.45 -0.00 0.18 0.00 -0.50 0.00 0.00 59.36 58.58 1bwe h GLU 62 Cb 1.32 -0.01 -0.12 0.00 -0.84 0.00 0.00 28.75 29.10 1bwe h GLU 62 CO 0.59 0.03 0.13 0.93 -1.40 0.00 0.00 179.01 179.29 1bwe h GLU 63 N 0.05 0.20 -0.01 2.33 3.07 -2.02 -1.92 114.58 116.28 1bwe h GLU 63 Ca 0.60 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 1bwe h GLU 63 Cb 1.25 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 1bwe h GLU 63 CO -0.85 0.13 -0.53 0.91 -1.40 0.00 0.00 179.01 177.27 1bwe n TRP 64 N -5.23 0.00 0.34 4.33 8.01 0.13 -3.88 117.44 121.13 1bwe n TRP 64 Ca 0.15 0.00 0.21 0.00 -1.31 0.00 0.00 57.50 56.56 1bwe n TRP 64 Cb 0.50 -0.06 1.15 0.00 -2.01 0.00 0.00 31.31 30.89 1bwe n TRP 64 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1bwe h LYS 65 N 1.30 0.00 -0.67 -0.99 1.57 0.24 0.14 116.57 118.16 1bwe h LYS 65 Ca 0.00 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 58.92 1bwe h LYS 65 Cb 0.61 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.81 1bwe h LYS 65 CO 0.00 0.00 0.11 0.66 -0.57 0.00 0.00 179.45 179.65 1bwe h SER 66 N 0.00 -0.08 -0.43 0.86 4.64 -1.67 0.61 113.55 117.48 1bwe h SER 66 Ca 0.00 0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 61.43 1bwe h SER 66 Cb 0.11 0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1bwe h SER 66 CO 0.00 -0.05 0.16 1.88 -0.87 0.00 0.00 176.83 177.95 1bwe h TYR 67 N 0.22 0.72 -0.29 4.77 0.05 -1.01 0.16 116.97 121.59 1bwe h TYR 67 Ca 0.37 -0.04 -0.04 0.00 0.05 0.00 0.00 58.73 59.06 1bwe h TYR 67 Cb 0.60 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.11 1bwe h TYR 67 CO -0.29 0.58 0.03 0.82 -1.05 0.00 0.00 178.16 178.25 1bwe h ILE 68 N 0.70 1.24 -0.81 -2.88 5.03 -0.98 0.28 117.51 120.10 1bwe h ILE 68 Ca 0.17 -0.86 0.06 0.00 -0.12 0.00 0.00 64.86 64.10 1bwe h ILE 68 Cb 0.19 1.25 -0.06 0.00 -3.03 0.00 0.00 36.82 35.17 1bwe h ILE 68 CO -0.01 0.28 0.49 -0.61 -0.68 0.00 0.00 178.15 177.62 1bwe h GLN 69 N 0.29 0.89 -0.24 2.37 5.75 -0.67 0.99 115.11 124.50 1bwe h GLN 69 Ca 0.08 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 1bwe h GLN 69 Cb 0.38 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1bwe h GLN 69 CO 0.01 0.59 0.04 -0.22 -2.65 0.00 0.00 178.83 176.59 1bwe h LYS 70 N 0.91 0.39 -0.77 1.69 1.63 -0.38 0.13 116.57 120.18 1bwe h LYS 70 Ca 0.35 -0.11 0.04 0.00 -0.85 0.00 0.00 60.65 60.08 1bwe h LYS 70 Cb 0.14 -0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.68 1bwe h LYS 70 CO -0.16 0.53 0.49 -0.91 -3.45 0.00 0.00 179.45 175.94 1bwe h ASN 71 N 0.20 0.79 0.67 4.20 2.35 -0.19 0.05 115.58 123.64 1bwe h ASN 71 Ca 0.07 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1bwe h ASN 71 Cb 0.33 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 1bwe h ASN 71 CO 0.01 0.54 -0.42 -0.09 -1.65 0.00 0.00 177.43 175.81 1bwe h ARG 72 N 0.93 -0.98 -0.28 0.81 2.43 -0.63 -3.32 114.38 113.34 1bwe h ARG 72 Ca 0.32 0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.62 1bwe h ARG 72 Cb 0.05 0.22 -0.07 0.00 -0.42 0.00 0.00 29.97 29.76 1bwe h ARG 72 CO -0.13 -0.66 -0.17 0.22 -1.51 0.00 0.00 179.97 177.72 1bwe h ASP 73 N -1.02 -0.57 -0.65 -3.80 3.58 -0.75 -3.16 116.42 110.05 1bwe h ASP 73 Ca -0.09 0.12 0.12 0.00 0.42 0.00 0.00 57.03 57.61 1bwe h ASP 73 Cb 0.82 0.30 -0.12 0.00 1.72 0.00 0.00 39.33 42.05 1bwe h ASP 73 CO 0.09 -0.21 -0.18 0.49 -2.88 0.00 0.00 179.24 176.54 1bwe n PHE 74 N -5.34 0.19 0.50 0.28 3.72 -0.01 -0.98 117.46 115.81 1bwe n PHE 74 Ca -0.00 0.79 0.06 0.00 -0.05 0.00 0.00 57.45 58.25 1bwe n PHE 74 Cb 0.25 -0.85 0.04 0.00 -0.94 0.00 0.00 39.48 37.98 1bwe n PHE 74 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 1bwe n PHE 75 N -5.04 0.00 0.10 1.38 3.72 -1.21 -4.60 117.46 111.81 1bwe n PHE 75 Ca 0.10 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.35 1bwe n PHE 75 Cb 0.31 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.73 1bwe n PHE 75 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1bwe h LYS 76 N 2.08 0.24 0.00 -1.08 6.56 -1.03 -3.53 116.57 119.82 1bwe h LYS 76 Ca 0.00 -0.40 0.00 0.00 -1.06 0.00 0.00 60.65 59.19 1bwe h LYS 76 Cb 0.47 0.14 0.00 0.00 -0.57 0.00 0.00 32.23 32.27 1bwe h LYS 76 CO 0.00 1.17 0.00 0.36 -2.06 0.00 0.00 179.45 178.92